| CAS Number | 1443980-07-1 |
| Catalog Number | AG01A5ID(AGN-PC-0WOQTN) |
| Chemical Name | 3-(2-aminoethanesulfonyl)prop-1-yne hydrochloride |
| IUPAC Name | 2-prop-2-ynylsulfonylethanamine;hydrochloride |
| InChI | InChI=1S/C5H9NO2S.ClH/c1-2-4-9(7,8)5-3-6;/h1H,3-6H2;1H |
| InChI Key | OIDJBOIGRUDPOT-UHFFFAOYSA-N |
| MDL Number | MFCD24842915 |
| Molecular Formula | C5H10ClNO2S |
| Molecular Weight | 183.6564 |
| SMILES | Cl.NCCS(CC#C)(=O)=O |
| Synonyms | 3-(2-aminoethanesulfonyl)prop-1-yne hydrochloride,
1443980-07-1,
AKOS026741303,
EN300-128987,
F8887-5519,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.012077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.66g/mol |
| Monoisotopic Mass | 183.012077g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 68.5Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number